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Target
Beta-secretase 1
Ligand
BDBM50392774
Substrate
n/a
Meas. Tech.
ChEMBL_853104 (CHEMBL2154572)
IC50
110±n/a nM
Citation
 Kaller, MR; Harried, SS; Albrecht, B; Amarante, P; Babu-Khan, S; Bartberger, MD; Brown, J; Brown, R; Chen, K; Cheng, Y; Citron, M; Croghan, MD; Graceffa, R; Hickman, D; Judd, T; Kriemen, C; La, D; Li, V; Lopez, P; Luo, Y; Masse, C; Monenschein, H; Nguyen, T; Pennington, LD; Miguel, TS; Sickmier, EA; Wahl, RC; Weiss, MM; Wen, PH; Williamson, T; Wood, S; Xue, M; Yang, B; Zhang, J; Patel, V; Zhong, W; Hitchcock, S A Potent and Orally Efficacious, Hydroxyethylamine-Based Inhibitor of ß-Secretase. ACS Med Chem Lett 3:886-891 (2012) [PubMed]  Article 
Target
Name:
Beta-secretase 1
Synonyms:
ASP2 | Asp 2 | Aspartyl protease 2 | BACE | BACE1 | BACE1_HUMAN | Beta-secretase (BACE) | Beta-secretase 1 | Beta-secretase 1 (BACE 1) | Beta-secretase 1 (BACE-1) | Beta-secretase 1 (BACE1) | Beta-site APP cleaving enzyme 1 | Beta-site amyloid precursor protein cleaving enzyme 1 | KIAA1149 | Memapsin-2 | Membrane-associated aspartic protease 2 | beta-Secretase (BACE-1) | beta-Secretase (BACE1)
Type:
Protein
Mol. Mass.:
55755.10
Organism:
Homo sapiens (Human)
Description:
P56817
Residue:
501
Sequence:
MAQALPWLLLWMGAGVLPAHGTQHGIRLPLRSGLGGAPLGLRLPRETDEEPEEPGRRGSFVEMVDNLRGKSGQGYYVEMTVGSPPQTLNILVDTGSSNFAVGAAPHPFLHRYYQRQLSSTYRDLRKGVYVPYTQGKWEGELGTDLVSIPHGPNVTVRANIAAITESDKFFINGSNWEGILGLAYAEIARPDDSLEPFFDSLVKQTHVPNLFSLQLCGAGFPLNQSEVLASVGGSMIIGGIDHSLYTGSLWYTPIRREWYYEVIIVRVEINGQDLKMDCKEYNYDKSIVDSGTTNLRLPKKVFEAAVKSIKAASSTEKFPDGFWLGEQLVCWQAGTTPWNIFPVISLYLMGEVTNQSFRITILPQQYLRPVEDVATSQDDCYKFAISQSSTGTVMGAVIMEGFYVVFDRARKRIGFAVSACHVHDEFRTAAVEGPFVTLDMEDCGYNIPQTDESTLMTIAYVMAAICALFMLPLCLMVCQWRCLRCLRQQHDDFADDISLLK
  
Inhibitor
Name:
BDBM50392774
Synonyms:
CHEMBL2151149
Type:
Small organic molecule
Emp. Form.:
C26H34N2O3
Mol. Mass.:
422.5598
SMILES:
CCc1ccc2OC3(CCC3)C[C@H](NC[C@@H](O)[C@H](Cc3ccccc3)NC(C)=O)c2c1 |r|
Structure:
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